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U.S. Department of Energy
Office of Scientific and Technical Information

Direct determination of atom and radical concentrations in thermal reactions of hydrocarbons and other gases

Technical Report ·
OSTI ID:5455724

This is the sixth annual progress report on this project. During the period covered by the first five reports (June 1976 through December 1980) a shock tube and optical systems to measure H, D and O atom concentrations were built and fully characterized. The performance of our microwave discharge lamps was defined by numerous high-resolution spectroscopic profiles, while empirical calibrations were also made for all three of the above species. H, D and O atom concentrations were measured in gas mixtures containing H/sub 2/, D/sub 2/, O/sub 2/, CD/sub 4/, C/sub 2/H/sub 6/, C/sub 2/D/sub 6/, C/sub 3/H/sub 8/ and C/sub 3/D/sub 8/ in various proportions, and rate constants of several elementary reactions were deduced from the data. During the period covered by this report (January 1 to November 30, 1981) we have made an extensive series of measurements of O concentrations in shock-heated mixtures of C/sub 2/H/sub 6/-O/sub 2/-AR, C/sub 2/D/sub 6/-O/sub 2/-Ar, C/sub 3/H/sub 8/-O/sub 2/-Ar and C/sub 3/D/sub 8/-O/sub 2/-Ar. We have made kinetic modelling calculations for these mixtures to correlate these observed O concentrations, and also our earlier measurements of H and D atom concentrations in similar mixtures, with elementary reaction rate constants. From these calculations we expect to deduce rate constants for a number of reactions. We have also completed a series of O atom measurements in H/sub 2/-N/sub 2/O-Ar and D/sub 2/-N/sub 2/O-Ar mixtures, from which we have obtained good rate constant data for the reactions O + H/sub 2/ ..-->.. OH + H and O + D/sub 2/ ..-->.. OD + D. Our immediate future plans involve meaurements of H and D atoms in the dissociation of benzene, toluene, neopentane and their deuterium analogs leading to direct evaluation of rate constants for the unimolecular dissociation of these substances.

Research Organization:
Wright State Univ., Dayton, OH (USA)
DOE Contract Number:
AS02-76ER02944
OSTI ID:
5455724
Report Number(s):
DOE/ER/02944-6; ON: DE82010480
Country of Publication:
United States
Language:
English